sodium;pyridine-2-carboxylic acid;hydroxide

C6H6NNaO3 — CID 162223571

IUPACsodium;pyridine-2-carboxylic acid;hydroxide
SMILESO=C(O)c1ccccn1.[Na+].[OH-]
InChIInChI=1S/C6H5NO2.Na.H2O/c8-6(9)5-3-1-2-4-7-5;;/h1-4H,(H,8,9);;1H2/q;+1;/p-1
InChIKeyZULLVVYTBDCWRI-UHFFFAOYSA-M
MW163.11 g/mol
LogP-2.39
Rot. Bonds1

About sodium;pyridine-2-carboxylic acid;hydroxide

sodium;pyridine-2-carboxylic acid;hydroxide (PubChem CID 162223571) has the molecular formula C6H6NNaO3 and a molecular weight of 163.11 g/mol. Its IUPAC name is sodium;pyridine-2-carboxylic acid;hydroxide.

Molecular Properties

Compound Namesodium;pyridine-2-carboxylic acid;hydroxide
PubChem CID162223571
Molecular FormulaC6H6NNaO3
Molecular Weight163.11 g/mol
Exact Mass163.02
IUPAC Namesodium;pyridine-2-carboxylic acid;hydroxide
SMILESO=C(O)c1ccccn1.[Na+].[OH-]
InChIInChI=1S/C6H5NO2.Na.H2O/c8-6(9)5-3-1-2-4-7-5;;/h1-4H,(H,8,9);;1H2/q;+1;/p-1
InChIKeyZULLVVYTBDCWRI-UHFFFAOYSA-M
XLogP-2.39
TPSA80.19 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500163.11
LogP ≤ 5-2.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of sodium;pyridine-2-carboxylic acid;hydroxide?
The IUPAC name of sodium;pyridine-2-carboxylic acid;hydroxide (CID 162223571) is sodium;pyridine-2-carboxylic acid;hydroxide.
What is the SMILES notation for sodium;pyridine-2-carboxylic acid;hydroxide?
The canonical SMILES for sodium;pyridine-2-carboxylic acid;hydroxide is O=C(O)c1ccccn1.[Na+].[OH-].
What is the InChIKey of sodium;pyridine-2-carboxylic acid;hydroxide?
The InChIKey is ZULLVVYTBDCWRI-UHFFFAOYSA-M. The full InChI is InChI=1S/C6H5NO2.Na.H2O/c8-6(9)5-3-1-2-4-7-5;;/h1-4H,(H,8,9);;1H2/q;+1;/p-1.
What are the key properties of sodium;pyridine-2-carboxylic acid;hydroxide?
sodium;pyridine-2-carboxylic acid;hydroxide has a molecular weight of 163.11 g/mol, XLogP of -2.39, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for sodium;pyridine-2-carboxylic acid;hydroxide is sourced from PubChem (CID 162223571), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).